F595-0080 Screening compound: 1-{[7-(4-fluorophenyl)-5H,6H,7H-imidazo[2,1-c][1,2,4]triazol-3-yl]sulfanyl}propan-2-one

F595-0080 Screening compound: 1-{[7-(4-fluorophenyl)-5H,6H,7H-imidazo[2,1-c][1,2,4]triazol-3-yl]sulfanyl}propan-2-one
F595-0080 Screening compound: 1-{[7-(4-fluorophenyl)-5H,6H,7H-imidazo[2,1-c][1,2,4]triazol-3-yl]sulfanyl}propan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F595-0080
1-{[7-(4-fluorophenyl)-5H,6H,7H-imidazo[2,1-c][1,2,4]triazol-3-yl]sulfanyl}propan-2-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

F595-0080

Molecular Formula

C13H13FN4OS (C13 H13 FN4 OS)

Compound Name

1-{[7-(4-fluorophenyl)-5H,6H,7H-imidazo[2,1-c][1,2,4]triazol-3-yl]sulfanyl}propan-2-one

IUPAC name

1-{[7-(4-fluorophenyl)-5H6H7H-imidazo[21-c][124]triazol-3-yl]sulfanyl}propan-2-one

SMILES

CC(CSc(n1CC2)nnc1N2c(cc1)ccc1F)=O

InChI

InChI=1S/C13H13FN4OS/c1-9(19)8-20-13-16-15-12-17(6-7-18(12)13)11-4-2-10(14)3-5-11/h2-5H,6-8H2,1H3

InChI Key

BFMWYXVYLLVIEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08537865

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.047

Distribution Coefficient, logD

1.977

Water Solubility, LogSw

-2.29

Polar Surface Area

40.329

Acid Dissociation Constant (pKa)

17.75

Base Dissociation Constant (pKb)

6.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

F595-0080 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F595-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F595-0080?
Check Price and Availability of F595-0080, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F595-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F595-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F595-0080
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of F595-0080 available by request